3-[[6-(1,3-benzodioxol-5-yl)-4-oxidanylidene-1H-pyrimidin-2-yl]amino]benzenesulfonamide

Systemtic Name: 3-[[6-(1,3-benzodioxol-5-yl)-4-oxidanylidene-1H-pyrimidin-2-yl]amino]benzenesulfonamide Openeye Name: 3-[[6-(1,3-benzodioxol-5-yl)-4-oxo-1H-pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: 3-[[6-(1,3-benzodioxol-5-yl)-4-oxo-1H-pyrimidin-2-yl]amino]benzenesulfonamide IUPAC Name: 3-[[6-(1,3-benzodioxol-5-yl)-4-oxo-1H-pyrimidin-2-yl]amino]benzenesulfonamide Traditional Name: 3-[[6-(1,3-benzodioxol-5-yl)-4-keto-1H-pyrimidin-2-yl]amino]benzenesulfonamide Formula: C17H14N4O5S MolecularWeight: 386.38186

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CC(=O)N=C(N3)NC4=CC(=CC=C4)S(=O)(=O)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CC(=O)N=C(N3)NC4=CC(=CC=C4)S(=O)(=O)N

InChI

InChI=1S/C17H14N4O5S/c18-27(23,24)12-3-1-2-11(7-12)19-17-20-13(8-16(22)21-17)10-4-5-14-15(6-10)26-9-25-14/h1-8H,9H2,(H2,18,23,24)(H2,19,20,21,22)